1-[2-(benzotriazol-1-yl)ethanoylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[2-(benzotriazol-1-yl)ethanoylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-benzyl-thiourea CAS Name: 1-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-benzylthiourea Traditional Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-benzyl-thiourea Formula: C16H16N6OS MolecularWeight: 340.40284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H16N6OS/c23-15(11-22-14-9-5-4-8-13(14)18-21-22)19-20-16(24)17-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,19,23)(H2,17,20,24)