3-(4-chlorophenyl)-1-[3-(3-methylpiperidin-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(4-chlorophenyl)-1-[3-(3-methylpiperidin-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(4-chlorophenyl)-1-[3-(3-methyl-1-piperidyl)propyl]-1-(2-thienylmethyl)thiourea CAS Name: 3-(4-chlorophenyl)-1-[3-(3-methyl-1-piperidinyl)propyl]-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(4-chlorophenyl)-1-[3-(3-methylpiperidin-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(4-chlorophenyl)-1-[3-(3-methylpiperidino)propyl]-1-(2-thenyl)thiourea Formula: C21H28ClN3S2 MolecularWeight: 422.05012

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCN(CC2=CC=CS2)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CCCN(C1)CCCN(CC2=CC=CS2)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H28ClN3S2/c1-17-5-2-11-24(15-17)12-4-13-25(16-20-6-3-14-27-20)21(26)23-19-9-7-18(22)8-10-19/h3,6-10,14,17H,2,4-5,11-13,15-16H2,1H3,(H,23,26)