4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methyl-aniline

Systemtic Name: 4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methyl-aniline Openeye Name: 4-[3-[4-(benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methyl-aniline CAS Name: 4-[3-[4-(1-benzothiophen-4-yl)-1-piperazinyl]propoxy]-3-methoxy-5-methylaniline IUPAC Name: 4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methylaniline Traditional Name: [4-[3-[4-(benzothiophen-4-yl)piperazino]propoxy]-3-methoxy-5-methyl-phenyl]amine Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3)OC)N

Isomeric SMILES

CC1=CC(=CC(=C1OCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3)OC)N

InChI

InChI=1S/C23H29N3O2S/c1-17-15-18(24)16-21(27-2)23(17)28-13-4-8-25-9-11-26(12-10-25)20-5-3-6-22-19(20)7-14-29-22/h3,5-7,14-16H,4,8-13,24H2,1-2H3