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

Systemtic Name: 1-[[4-(benzotriazol-1-ylmethyl)phenyl]carbonylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[[4-(benzotriazol-1-ylmethyl)benzoyl]amino]-3-isoamyl-thiourea Formula: C20H24N6OS MolecularWeight: 396.50916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N6OS/c1-14(2)11-12-21-20(28)24-23-19(27)16-9-7-15(8-10-16)13-26-18-6-4-3-5-17(18)22-25-26/h3-10,14H,11-13H2,1-2H3,(H,23,27)(H2,21,24,28)