1-phenyl-3-[4-(phenylcarbamothioylamino)butyl]thiourea

Systemtic Name: 1-phenyl-3-[4-(phenylcarbamothioylamino)butyl]thiourea Openeye Name: 1-phenyl-3-[4-(phenylcarbamothioylamino)butyl]thiourea CAS Name: 1-[4-[[anilino(sulfanylidene)methyl]amino]butyl]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[4-(phenylcarbamothioylamino)butyl]thiourea Traditional Name: 1-phenyl-3-[4-(phenylthiocarbamoylamino)butyl]thiourea Formula: C18H22N4S2 MolecularWeight: 358.52408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCCCCNC(=S)NC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCCCCNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C18H22N4S2/c23-17(21-15-9-3-1-4-10-15)19-13-7-8-14-20-18(24)22-16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H2,19,21,23)(H2,20,22,24)