1-[2-(3,4-diethoxyphenyl)ethanoylamino]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea

Systemtic Name: 1-[2-(3,4-diethoxyphenyl)ethanoylamino]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[[2-(3,4-diethoxyphenyl)-1-oxoethyl]amino]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=O)NNC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=O)NNC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C)OCC

InChI

InChI=1S/C23H25N3O5S/c1-4-29-18-9-6-15(11-20(18)30-5-2)12-21(27)25-26-23(32)24-16-7-8-17-14(3)10-22(28)31-19(17)13-16/h6-11,13H,4-5,12H2,1-3H3,(H,25,27)(H2,24,26,32)