N-[4-[6-methoxy-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-[6-methoxy-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl]ethanamide Openeye Name: N-[4-[6-methoxy-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)benzoyl]benzothiophen-2-yl]phenyl]acetamide CAS Name: N-[4-[6-methoxy-3-[[3-methyl-4-(1-pyrrolidinylmethyl)phenyl]-oxomethyl]-1-benzothiophen-2-yl]phenyl]acetamide IUPAC Name: N-[4-[6-methoxy-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)benzoyl]-1-benzothiophen-2-yl]phenyl]acetamide Traditional Name: N-[4-[6-methoxy-3-[3-methyl-4-(pyrrolidinomethyl)benzoyl]benzothiophen-2-yl]phenyl]acetamide Formula: C30H30N2O3S MolecularWeight: 498.6358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OC)C4=CC=C(C=C4)NC(=O)C)CN5CCCC5

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OC)C4=CC=C(C=C4)NC(=O)C)CN5CCCC5

InChI

InChI=1S/C30H30N2O3S/c1-19-16-22(6-7-23(19)18-32-14-4-5-15-32)29(34)28-26-13-12-25(35-3)17-27(26)36-30(28)21-8-10-24(11-9-21)31-20(2)33/h6-13,16-17H,4-5,14-15,18H2,1-3H3,(H,31,33)