8-methoxy-4-oxidanylidene-N-(4-phenylbutan-2-yl)pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide

Systemtic Name: 8-methoxy-4-oxidanylidene-N-(4-phenylbutan-2-yl)pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide Openeye Name: 8-methoxy-N-(1-methyl-3-phenyl-propyl)-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide CAS Name: 8-methoxy-4-oxo-N-(4-phenylbutan-2-yl)-3-pyrimido[2,1-b][1,3]benzothiazolecarboxamide IUPAC Name: 8-methoxy-4-oxo-N-(4-phenylbutan-2-yl)pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide Traditional Name: 4-keto-8-methoxy-N-(1-methyl-3-phenyl-propyl)pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CN=C3N(C2=O)C4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=CN=C3N(C2=O)C4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C22H21N3O3S/c1-14(8-9-15-6-4-3-5-7-15)24-20(26)17-13-23-22-25(21(17)27)18-11-10-16(28-2)12-19(18)29-22/h3-7,10-14H,8-9H2,1-2H3,(H,24,26)