1-(3-methylbutyl)-3-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]thiourea Openeye Name: 1-isopentyl-3-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoylamino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[1-oxo-3-(3-oxo-1,4-benzoxazin-4-yl)propyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoylamino]thiourea Traditional Name: 1-isoamyl-3-[3-(3-keto-1,4-benzoxazin-4-yl)propanoylamino]thiourea Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CCN1C(=O)COC2=CC=CC=C21

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)CCN1C(=O)COC2=CC=CC=C21

InChI

InChI=1S/C17H24N4O3S/c1-12(2)7-9-18-17(25)20-19-15(22)8-10-21-13-5-3-4-6-14(13)24-11-16(21)23/h3-6,12H,7-11H2,1-2H3,(H,19,22)(H2,18,20,25)