1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC(C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC(C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O4S/c1-11-7-19(23)26-17-9-14(4-5-15(11)17)22-20(27)21-12(2)13-3-6-16-18(8-13)25-10-24-16/h3-9,12H,10H2,1-2H3,(H2,21,22,27)