1-(4-ethoxyphenyl)-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]thiourea

Systemtic Name: 1-(4-ethoxyphenyl)-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]thiourea Openeye Name: 1-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(4-ethoxyphenyl)thiourea CAS Name: 1-(4-ethoxyphenyl)-3-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]thiourea IUPAC Name: 1-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-[2-(4-benzylpiperazino)ethyl]-3-p-phenetyl-thiourea Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N4OS/c1-2-27-21-10-8-20(9-11-21)24-22(28)23-12-13-25-14-16-26(17-15-25)18-19-6-4-3-5-7-19/h3-11H,2,12-18H2,1H3,(H2,23,24,28)