1-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-[(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNNC(=S)NCC=C)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=CNNC(=S)NCC=C)C=C(C1=O)C

InChI

InChI=1S/C13H17N3OS/c1-4-5-14-13(18)16-15-8-11-6-9(2)12(17)10(3)7-11/h4,6-8,15H,1,5H2,2-3H3,(H2,14,16,18)