N-[5-(4-methoxy-2-methyl-5-morpholin-4-ylcarbonyl-phenyl)sulfanyl-1,3-thiazol-2-yl]-5-[(propan-2-ylamino)methyl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[5-(4-methoxy-2-methyl-5-morpholin-4-ylcarbonyl-phenyl)sulfanyl-1,3-thiazol-2-yl]-5-[(propan-2-ylamino)methyl]-1H-pyrrole-2-carboxamide Openeye Name: 5-[(isopropylamino)methyl]-N-[5-[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]sulfanylthiazol-2-yl]-1H-pyrrole-2-carboxamide CAS Name: N-[5-[[4-methoxy-2-methyl-5-[4-morpholinyl(oxo)methyl]phenyl]thio]-2-thiazolyl]-5-[(propan-2-ylamino)methyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[5-[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]sulfanyl-1,3-thiazol-2-yl]-5-[(propan-2-ylamino)methyl]-1H-pyrrole-2-carboxamide Traditional Name: 5-[(isopropylamino)methyl]-N-[5-[[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]thio]thiazol-2-yl]-1H-pyrrole-2-carboxamide Formula: C25H31N5O4S2 MolecularWeight: 529.67474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)OC)C(=O)N2CCOCC2)SC3=CN=C(S3)NC(=O)C4=CC=C(N4)CNC(C)C

Isomeric SMILES

CC1=C(C=C(C(=C1)OC)C(=O)N2CCOCC2)SC3=CN=C(S3)NC(=O)C4=CC=C(N4)CNC(C)C

InChI

InChI=1S/C25H31N5O4S2/c1-15(2)26-13-17-5-6-19(28-17)23(31)29-25-27-14-22(36-25)35-21-12-18(20(33-4)11-16(21)3)24(32)30-7-9-34-10-8-30/h5-6,11-12,14-15,26,28H,7-10,13H2,1-4H3,(H,27,29,31)