1-(1-methylindol-5-yl)-3-[[(E)-(4-oxidanyl-6-oxidanylidene-3-propan-2-yl-cyclohexa-2,4-dien-1-ylidene)-sulfanyl-methyl]amino]urea

Systemtic Name: 1-(1-methylindol-5-yl)-3-[[(E)-(4-oxidanyl-6-oxidanylidene-3-propan-2-yl-cyclohexa-2,4-dien-1-ylidene)-sulfanyl-methyl]amino]urea Openeye Name: 1-[[(E)-(4-hydroxy-3-isopropyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-sulfanyl-methyl]amino]-3-(1-methylindol-5-yl)urea CAS Name: 1-[[(E)-(4-hydroxy-6-oxo-3-propan-2-yl-1-cyclohexa-2,4-dienylidene)-mercaptomethyl]amino]-3-(1-methyl-5-indolyl)urea IUPAC Name: 1-[[(E)-(4-hydroxy-6-oxo-3-propan-2-ylcyclohexa-2,4-dien-1-ylidene)-sulfanylmethyl]amino]-3-(1-methylindol-5-yl)urea Traditional Name: 1-[[(E)-(4-hydroxy-3-isopropyl-6-keto-cyclohexa-2,4-dien-1-ylidene)-mercapto-methyl]amino]-3-(1-methylindol-5-yl)urea Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(NNC(=O)NC2=CC3=C(C=C2)N(C=C3)C)S)C(=O)C=C1O

Isomeric SMILES

CC(C)C1=C/C(=C(/NNC(=O)NC2=CC3=C(C=C2)N(C=C3)C)\S)/C(=O)C=C1O

InChI

InChI=1S/C20H22N4O3S/c1-11(2)14-9-15(18(26)10-17(14)25)19(28)22-23-20(27)21-13-4-5-16-12(8-13)6-7-24(16)3/h4-11,22,25,28H,1-3H3,(H2,21,23,27)/b19-15+