N-[4,5-bis(4-tert-butylphenyl)-1,3-thiazol-2-yl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzamide

Systemtic Name: N-[4,5-bis(4-tert-butylphenyl)-1,3-thiazol-2-yl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzamide Openeye Name: N-[4,5-bis(4-tert-butylphenyl)thiazol-2-yl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzamide CAS Name: N-[4,5-bis(4-tert-butylphenyl)-2-thiazolyl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxybenzamide IUPAC Name: N-[4,5-bis(4-tert-butylphenyl)-1,3-thiazol-2-yl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxybenzamide Traditional Name: N-[4,5-bis(4-tert-butylphenyl)thiazol-2-yl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzamide Formula: C40H43N3O4S2 MolecularWeight: 693.91712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC5=CC=CC=C54)C6=CC=C(C=C6)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC5=CC=CC=C54)C6=CC=C(C=C6)C(C)(C)C

InChI

InChI=1S/C40H43N3O4S2/c1-39(2,3)30-19-14-27(15-20-30)35-36(28-16-21-31(22-17-28)40(4,5)6)48-38(41-35)42-37(44)29-18-23-33(47-7)34(25-29)49(45,46)43-24-10-12-26-11-8-9-13-32(26)43/h8-9,11,13-23,25H,10,12,24H2,1-7H3,(H,41,42,44)