1-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-chloranyl-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-3-propan-2-yl-thiourea

Systemtic Name: 1-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-chloranyl-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-3-propan-2-yl-thiourea Openeye Name: 1-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-chloro-6-oxo-cyclohexa-1,4-dien-1-yl]-3-isopropyl-thiourea CAS Name: 1-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-chloro-6-oxo-1-cyclohexa-1,4-dienyl]-3-propan-2-ylthiourea IUPAC Name: 1-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-chloro-6-oxocyclohexa-1,4-dien-1-yl]-3-propan-2-ylthiourea Traditional Name: 1-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-5-chloro-6-keto-cyclohexa-1,4-dien-1-yl]-3-isopropyl-thiourea Formula: C17H16ClN3OS2 MolecularWeight: 377.91144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CC(=C2NC3=CC=CC=C3S2)C=C(C1=O)Cl

Isomeric SMILES

CC(C)NC(=S)NC1=C/C(=C/2\NC3=CC=CC=C3S2)/C=C(C1=O)Cl

InChI

InChI=1S/C17H16ClN3OS2/c1-9(2)19-17(23)21-13-8-10(7-11(18)15(13)22)16-20-12-5-3-4-6-14(12)24-16/h3-9,20H,1-2H3,(H2,19,21,23)/b16-10+