1-[(E)-[4-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-4-phenyl-butan-2-ylidene]amino]thiourea

Systemtic Name: 1-[(E)-[4-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-4-phenyl-butan-2-ylidene]amino]thiourea Openeye Name: [(E)-[3-(2-hydroxy-4-oxo-chromen-3-yl)-1-methyl-3-phenyl-propylidene]amino]thiourea CAS Name: [(E)-[4-(2-hydroxy-4-oxo-1-benzopyran-3-yl)-4-phenylbutan-2-ylidene]amino]thiourea IUPAC Name: [(E)-[4-(2-hydroxy-4-oxochromen-3-yl)-4-phenylbutan-2-ylidene]amino]thiourea Traditional Name: [(E)-[3-(2-hydroxy-4-keto-chromen-3-yl)-1-methyl-3-phenyl-propylidene]amino]thiourea Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N)CC(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O

Isomeric SMILES

C/C(=N\NC(=S)N)/CC(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C20H19N3O3S/c1-12(22-23-20(21)27)11-15(13-7-3-2-4-8-13)17-18(24)14-9-5-6-10-16(14)26-19(17)25/h2-10,15,25H,11H2,1H3,(H3,21,23,27)/b22-12+