4-butoxy-N-[2-[(4-butoxyphenyl)carbonylamino]-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-butoxy-N-[2-[(4-butoxyphenyl)carbonylamino]-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-butoxy-N-[2-[(4-butoxybenzoyl)amino]-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-butoxy-N-[2-[[(4-butoxyphenyl)-oxomethyl]amino]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-butoxy-N-[2-[(4-butoxybenzoyl)amino]-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-butoxy-N-[2-[(4-butoxybenzoyl)amino]-1,3-benzothiazol-6-yl]benzamide Formula: C29H31N3O4S MolecularWeight: 517.63914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)OCCCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)OCCCC

InChI

InChI=1S/C29H31N3O4S/c1-3-5-17-35-23-12-7-20(8-13-23)27(33)30-22-11-16-25-26(19-22)37-29(31-25)32-28(34)21-9-14-24(15-10-21)36-18-6-4-2/h7-16,19H,3-6,17-18H2,1-2H3,(H,30,33)(H,31,32,34)