1-[3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]thiourea

Systemtic Name: 1-[3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]thiourea Openeye Name: [3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]thiourea CAS Name: [3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-1-cyclohexa-1,5-dienyl]thiourea IUPAC Name: [3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxocyclohexa-1,5-dien-1-yl]thiourea Traditional Name: [3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]thiourea Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2NC3=C(O2)C=C(C(=C3)C)C)C1=O)NC(=S)N

Isomeric SMILES

CC1=CC(=CC(=C2NC3=C(O2)C=C(C(=C3)C)C)C1=O)NC(=S)N

InChI

InChI=1S/C17H17N3O2S/c1-8-5-13-14(6-9(8)2)22-16(20-13)12-7-11(19-17(18)23)4-10(3)15(12)21/h4-7,20H,1-3H3,(H3,18,19,23)