1-(4-cyanobutyl)-3-[C-phenyl-N-(phenylmethyl)carbonimidoyl]thiourea

Systemtic Name: 1-(4-cyanobutyl)-3-[C-phenyl-N-(phenylmethyl)carbonimidoyl]thiourea Openeye Name: 1-(N-benzyl-C-phenyl-carbonimidoyl)-3-(4-cyanobutyl)thiourea CAS Name: 1-(4-cyanobutyl)-3-[phenyl-(phenylmethyl)iminomethyl]thiourea IUPAC Name: 1-(N-benzyl-C-phenylcarbonimidoyl)-3-(4-cyanobutyl)thiourea Traditional Name: 1-(N-benzyl-C-phenyl-carbonimidoyl)-3-(4-cyanobutyl)thiourea Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C(C2=CC=CC=C2)NC(=S)NCCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)CN=C(C2=CC=CC=C2)NC(=S)NCCCCC#N

InChI

InChI=1S/C20H22N4S/c21-14-8-3-9-15-22-20(25)24-19(18-12-6-2-7-13-18)23-16-17-10-4-1-5-11-17/h1-2,4-7,10-13H,3,8-9,15-16H2,(H2,22,23,24,25)