1-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)propylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)propylamino]-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-[1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)propylamino]thiourea CAS Name: 1-[1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)propylamino]-3-propan-2-ylthiourea IUPAC Name: 1-[1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)propylamino]-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-[1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)propylamino]thiourea Formula: C14H21N3OS MolecularWeight: 279.40104

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=C(C=CC1=O)C)NNC(=S)NC(C)C

Isomeric SMILES

CCC(=C1C=C(C=CC1=O)C)NNC(=S)NC(C)C

InChI

InChI=1S/C14H21N3OS/c1-5-12(16-17-14(19)15-9(2)3)11-8-10(4)6-7-13(11)18/h6-9,16H,5H2,1-4H3,(H2,15,17,19)