[2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methanone

Systemtic Name: [2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methanone Openeye Name: [2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-benzothiophen-3-yl]-[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methanone CAS Name: [2-[4-[2-[2-(hydroxymethyl)-1-pyrrolidinyl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]methanone IUPAC Name: [2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methanone Traditional Name: [3-methoxy-4-(pyrrolidinomethyl)phenyl]-[6-methyl-2-[4-[2-(2-methylolpyrrolidino)ethoxy]phenyl]benzothiophen-3-yl]methanone Formula: C35H40N2O4S MolecularWeight: 584.7681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4CO)C(=O)C5=CC(=C(C=C5)CN6CCCC6)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4CO)C(=O)C5=CC(=C(C=C5)CN6CCCC6)OC

InChI

InChI=1S/C35H40N2O4S/c1-24-7-14-30-32(20-24)42-35(25-10-12-29(13-11-25)41-19-18-37-17-5-6-28(37)23-38)33(30)34(39)26-8-9-27(31(21-26)40-2)22-36-15-3-4-16-36/h7-14,20-21,28,38H,3-6,15-19,22-23H2,1-2H3