[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,4-diethoxyphenyl)methanone

Systemtic Name: [4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,4-diethoxyphenyl)methanone Openeye Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,4-diethoxyphenyl)methanone CAS Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-(3,4-diethoxyphenyl)methanone IUPAC Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,4-diethoxyphenyl)methanone Traditional Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazino]-(3,4-diethoxyphenyl)methanone Formula: C23H26ClN3O3S MolecularWeight: 459.98884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(C=CC(=C4S3)Cl)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(C=CC(=C4S3)Cl)C)OCC

InChI

InChI=1S/C23H26ClN3O3S/c1-4-29-18-9-7-16(14-19(18)30-5-2)22(28)26-10-12-27(13-11-26)23-25-20-15(3)6-8-17(24)21(20)31-23/h6-9,14H,4-5,10-13H2,1-3H3