2-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonyl]-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide

Systemtic Name: 2-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonyl]-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: 2-(2-acetamido-4-methyl-thiazol-5-yl)sulfonyl-N-[2-(diisopropylamino)ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: 2-[(2-acetamido-4-methyl-5-thiazolyl)sulfonyl]-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: 2-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonyl]-N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: 2-(2-acetamido-4-methyl-thiazol-5-yl)sulfonyl-N-[2-(diisopropylamino)ethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C30H39N5O5S2 MolecularWeight: 613.79116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)N2CCC3=C(C2C(=O)NCCN(C(C)C)C(C)C)C=CC(=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)N2CCC3=C(C2C(=O)NCCN(C(C)C)C(C)C)C=CC(=C3)OC4=CC=CC=C4

InChI

InChI=1S/C30H39N5O5S2/c1-19(2)34(20(3)4)17-15-31-28(37)27-26-13-12-25(40-24-10-8-7-9-11-24)18-23(26)14-16-35(27)42(38,39)29-21(5)32-30(41-29)33-22(6)36/h7-13,18-20,27H,14-17H2,1-6H3,(H,31,37)(H,32,33,36)