[1-[(3-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] 8-(1,3-benzothiazol-2-yl)naphthalene-1-carboxylate

Systemtic Name: [1-[(3-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] 8-(1,3-benzothiazol-2-yl)naphthalene-1-carboxylate Openeye Name: 1-(m-tolylcarbamoyl)propyl 8-(1,3-benzothiazol-2-yl)naphthalene-1-carboxylate CAS Name: 8-(1,3-benzothiazol-2-yl)-1-naphthalenecarboxylic acid [1-(3-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3-methylanilino)-1-oxobutan-2-yl] 8-(1,3-benzothiazol-2-yl)naphthalene-1-carboxylate Traditional Name: 8-(1,3-benzothiazol-2-yl)naphthalene-1-carboxylic acid 1-(m-tolylcarbamoyl)propyl ester Formula: C29H24N2O3S MolecularWeight: 480.57746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C29H24N2O3S/c1-3-24(27(32)30-20-12-6-9-18(2)17-20)34-29(33)22-14-8-11-19-10-7-13-21(26(19)22)28-31-23-15-4-5-16-25(23)35-28/h4-17,24H,3H2,1-2H3,(H,30,32)