N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-[(4-methoxyphenyl)thio]butyramide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N=C(S2)NC(=O)CCCSC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N=C(S2)NC(=O)CCCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N2O3S2/c1-13-6-11-16(25-3)18-19(13)27-20(22-18)21-17(23)5-4-12-26-15-9-7-14(24-2)8-10-15/h6-11H,4-5,12H2,1-3H3,(H,21,22,23)