1-(3-methylbutyl)-3-[2-[(2R)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[2-[(2R)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoylamino]thiourea Openeye Name: 1-isopentyl-3-[[2-[(2R)-3-oxo-4H-1,4-benzoxazin-2-yl]acetyl]amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[1-oxo-2-[(2R)-3-oxo-4H-1,4-benzoxazin-2-yl]ethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[[2-[(2R)-3-oxo-4H-1,4-benzoxazin-2-yl]acetyl]amino]thiourea Traditional Name: 1-isoamyl-3-[[2-[(2R)-3-keto-4H-1,4-benzoxazin-2-yl]acetyl]amino]thiourea Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CC1C(=O)NC2=CC=CC=C2O1

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C[C@@H]1C(=O)NC2=CC=CC=C2O1

InChI

InChI=1S/C16H22N4O3S/c1-10(2)7-8-17-16(24)20-19-14(21)9-13-15(22)18-11-5-3-4-6-12(11)23-13/h3-6,10,13H,7-9H2,1-2H3,(H,18,22)(H,19,21)(H2,17,20,24)/t13-/m1/s1