N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[18-[3-(4,5-dihydro-1,3-thiazol-2-ylamino)-3-oxidanylidene-propyl]-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanamide

Systemtic Name: N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[18-[3-(4,5-dihydro-1,3-thiazol-2-ylamino)-3-oxidanylidene-propyl]-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanamide Openeye Name: N-(4,5-dihydrothiazol-2-yl)-3-[18-[3-(4,5-dihydrothiazol-2-ylamino)-3-oxo-propyl]-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanamide CAS Name: N-(4,5-dihydrothiazol-2-yl)-3-[18-[3-(4,5-dihydrothiazol-2-ylamino)-3-oxopropyl]-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanamide IUPAC Name: N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[18-[3-(4,5-dihydro-1,3-thiazol-2-ylamino)-3-oxopropyl]-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanamide Traditional Name: 3-[18-[3-keto-3-(2-thiazolin-2-ylamino)propyl]-3,8,13,17-tetramethyl-22,23-dihydroporphin-2-yl]-N-(2-thiazolin-2-yl)propionamide Formula: C36H38N8O2S2 MolecularWeight: 678.86932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC3=C(C=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)NC6=NCCS6)CCC(=O)NC7=NCCS7)C)C

Isomeric SMILES

CC1=CC2=CC3=C(C=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)NC6=NCCS6)CCC(=O)NC7=NCCS7)C)C

InChI

InChI=1S/C36H38N8O2S2/c1-19-13-24-16-29-21(3)25(5-7-33(45)43-35-37-9-11-47-35)31(41-29)18-32-26(6-8-34(46)44-36-38-10-12-48-36)22(4)30(42-32)17-28-20(2)14-23(40-28)15-27(19)39-24/h13-18,39-40H,5-12H2,1-4H3,(H,37,43,45)(H,38,44,46)