1-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-isopropyl-thiourea CAS Name: 1-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-propan-2-ylthiourea IUPAC Name: 1-[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-propan-2-ylthiourea Traditional Name: 1-[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-isopropyl-thiourea Formula: C11H15N3O2S MolecularWeight: 253.3207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC=C1C=CC(=O)C=C1O

Isomeric SMILES

CC(C)NC(=S)NNC=C1C=CC(=O)C=C1O

InChI

InChI=1S/C11H15N3O2S/c1-7(2)13-11(17)14-12-6-8-3-4-9(15)5-10(8)16/h3-7,12,16H,1-2H3,(H2,13,14,17)