2-butyl-1,1-bis(oxidanylidene)-5-phenyl-4-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]-1,2-thiazol-3-one

Systemtic Name: 2-butyl-1,1-bis(oxidanylidene)-5-phenyl-4-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]-1,2-thiazol-3-one Openeye Name: 2-butyl-1,1-dioxo-5-phenyl-4-[(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]isothiazol-3-one CAS Name: 2-butyl-1,1-dioxo-5-phenyl-4-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]-3-isothiazolone IUPAC Name: 2-butyl-1,1-dioxo-5-phenyl-4-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]-1,2-thiazol-3-one Traditional Name: 2-butyl-1,1-diketo-5-phenyl-4-[(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]isothiazol-3-one Formula: C20H19N3O3S3 MolecularWeight: 445.57816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC4=C(C=C3)NC(=S)S4

Isomeric SMILES

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC4=C(C=C3)NC(=S)S4

InChI

InChI=1S/C20H19N3O3S3/c1-2-3-11-23-19(24)17(18(29(23,25)26)13-7-5-4-6-8-13)21-14-9-10-15-16(12-14)28-20(27)22-15/h4-10,12,21H,2-3,11H2,1H3,(H,22,27)