1-[(6-chloranyl-4-oxidanylidene-chromen-2-yl)carbonylamino]-3-[(2S)-2-methylheptyl]thiourea

Systemtic Name: 1-[(6-chloranyl-4-oxidanylidene-chromen-2-yl)carbonylamino]-3-[(2S)-2-methylheptyl]thiourea Openeye Name: 1-[(6-chloro-4-oxo-chromene-2-carbonyl)amino]-3-[(2S)-2-methylheptyl]thiourea CAS Name: 1-[[(6-chloro-4-oxo-1-benzopyran-2-yl)-oxomethyl]amino]-3-[(2S)-2-methylheptyl]thiourea IUPAC Name: 1-[(6-chloro-4-oxochromene-2-carbonyl)amino]-3-[(2S)-2-methylheptyl]thiourea Traditional Name: 1-[(6-chloro-4-keto-chromene-2-carbonyl)amino]-3-[(2S)-2-methylheptyl]thiourea Formula: C19H24ClN3O3S MolecularWeight: 409.93016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)C1=CC(=O)C2=C(O1)C=CC(=C2)Cl

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=O)C1=CC(=O)C2=C(O1)C=CC(=C2)Cl

InChI

InChI=1S/C19H24ClN3O3S/c1-3-4-5-6-12(2)11-21-19(27)23-22-18(25)17-10-15(24)14-9-13(20)7-8-16(14)26-17/h7-10,12H,3-6,11H2,1-2H3,(H,22,25)(H2,21,23,27)/t12-/m0/s1