[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: [2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: [2-(1-naphthylamino)-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: 3-(1,3-benzothiazol-2-yl)-2-propenoic acid [2-(1-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: [2-(naphthalen-1-ylamino)-2-oxoethyl] 3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: 3-(1,3-benzothiazol-2-yl)acrylic acid [2-keto-2-(1-naphthylamino)ethyl] ester Formula: C22H16N2O3S MolecularWeight: 388.43904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)COC(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)COC(=O)C=CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H16N2O3S/c25-20(23-17-10-5-7-15-6-1-2-8-16(15)17)14-27-22(26)13-12-21-24-18-9-3-4-11-19(18)28-21/h1-13H,14H2,(H,23,25)