1-phenethyl-3-[[3-[(phenethylcarbamothioylamino)methyl]phenyl]methyl]thiourea

Systemtic Name: 1-phenethyl-3-[[3-[(phenethylcarbamothioylamino)methyl]phenyl]methyl]thiourea Openeye Name: 1-phenethyl-3-[[3-[(phenethylcarbamothioylamino)methyl]phenyl]methyl]thiourea CAS Name: 1-phenethyl-3-[[3-[[[(phenethylamino)-sulfanylidenemethyl]amino]methyl]phenyl]methyl]thiourea IUPAC Name: 1-phenethyl-3-[[3-[(phenethylcarbamothioylamino)methyl]phenyl]methyl]thiourea Traditional Name: 1-phenethyl-3-[3-[(phenethylthiocarbamoylamino)methyl]benzyl]thiourea Formula: C26H30N4S2 MolecularWeight: 462.6732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NCC2=CC(=CC=C2)CNC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NCC2=CC(=CC=C2)CNC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C26H30N4S2/c31-25(27-16-14-21-8-3-1-4-9-21)29-19-23-12-7-13-24(18-23)20-30-26(32)28-17-15-22-10-5-2-6-11-22/h1-13,18H,14-17,19-20H2,(H2,27,29,31)(H2,28,30,32)