1-(3-chlorophenyl)-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]thiourea Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)O2)CCCC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)O2)CCCC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H17ClN4O3S/c19-12-5-3-6-13(11-12)20-17(27)22-21-16(24)9-4-10-23-14-7-1-2-8-15(14)26-18(23)25/h1-3,5-8,11H,4,9-10H2,(H,21,24)(H2,20,22,27)