1-[[4-(benzotriazol-1-ylmethyl)phenyl]carbonylamino]-3-tert-butyl-thiourea

Systemtic Name: 1-[[4-(benzotriazol-1-ylmethyl)phenyl]carbonylamino]-3-tert-butyl-thiourea Openeye Name: 1-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]-3-tert-butyl-thiourea CAS Name: 1-[[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]amino]-3-tert-butylthiourea IUPAC Name: 1-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]-3-tert-butylthiourea Traditional Name: 1-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]-3-tert-butyl-thiourea Formula: C19H22N6OS MolecularWeight: 382.48258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N6OS/c1-19(2,3)20-18(27)23-22-17(26)14-10-8-13(9-11-14)12-25-16-7-5-4-6-15(16)21-24-25/h4-11H,12H2,1-3H3,(H,22,26)(H2,20,23,27)