1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-pyridin-3-yl-thiourea

Systemtic Name: 1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-pyridin-3-yl-thiourea Openeye Name: 1-(4-methyl-2-oxo-chromen-7-yl)-3-(3-pyridyl)thiourea CAS Name: 1-(4-methyl-2-oxo-1-benzopyran-7-yl)-3-(3-pyridinyl)thiourea IUPAC Name: 1-(4-methyl-2-oxochromen-7-yl)-3-pyridin-3-ylthiourea Traditional Name: 1-(2-keto-4-methyl-chromen-7-yl)-3-(3-pyridyl)thiourea Formula: C16H13N3O2S MolecularWeight: 311.35832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CN=CC=C3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CN=CC=C3

InChI

InChI=1S/C16H13N3O2S/c1-10-7-15(20)21-14-8-11(4-5-13(10)14)18-16(22)19-12-3-2-6-17-9-12/h2-9H,1H3,(H2,18,19,22)