1-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]thiourea CAS Name: 1-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]thiourea Traditional Name: 1-benzyl-3-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]thiourea Formula: C20H27N4S+ MolecularWeight: 355.52018

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C20H26N4S/c1-2-23-12-14-24(15-13-23)19-10-8-18(9-11-19)22-20(25)21-16-17-6-4-3-5-7-17/h3-11H,2,12-16H2,1H3,(H2,21,22,25)/p+1