2-(azepan-1-yl)-5-(5-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)-1,3-thiazol-4-one

Systemtic Name: 2-(azepan-1-yl)-5-(5-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)-1,3-thiazol-4-one Openeye Name: 2-(azepan-1-yl)-5-(5-chloro-2-oxo-indolin-3-ylidene)thiazol-4-one CAS Name: 2-(1-azepanyl)-5-(5-chloro-2-oxo-1H-indol-3-ylidene)-4-thiazolone IUPAC Name: 2-(azepan-1-yl)-5-(5-chloro-2-oxo-1H-indol-3-ylidene)-1,3-thiazol-4-one Traditional Name: 2-(azepan-1-yl)-5-(5-chloro-2-keto-indolin-3-ylidene)-2-thiazolin-4-one Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=O)C(=C3C4=C(C=CC(=C4)Cl)NC3=O)S2

Isomeric SMILES

C1CCCN(CC1)C2=NC(=O)C(=C3C4=C(C=CC(=C4)Cl)NC3=O)S2

InChI

InChI=1S/C17H16ClN3O2S/c18-10-5-6-12-11(9-10)13(15(22)19-12)14-16(23)20-17(24-14)21-7-3-1-2-4-8-21/h5-6,9H,1-4,7-8H2,(H,19,22)