N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(4-keto-2-methyl-quinazolin-3-yl)propionamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4O2S/c1-15-24-17-8-3-2-7-16(17)22(28)26(15)14-12-20(27)23-13-6-11-21-25-18-9-4-5-10-19(18)29-21/h2-5,7-10H,6,11-14H2,1H3,(H,23,27)