N-[3-methoxy-4-(3-oxidanylidenebutyl)phenyl]-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzamide

Systemtic Name: N-[3-methoxy-4-(3-oxidanylidenebutyl)phenyl]-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzamide Openeye Name: N-[3-methoxy-4-(3-oxobutyl)phenyl]-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzamide CAS Name: N-[3-methoxy-4-(3-oxobutyl)phenyl]-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzamide IUPAC Name: N-[3-methoxy-4-(3-oxobutyl)phenyl]-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzamide Traditional Name: N-[4-(3-ketobutyl)-3-methoxy-phenyl]-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)NC3=NCCCN3)OC

Isomeric SMILES

CC(=O)CCC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)NC3=NCCCN3)OC

InChI

InChI=1S/C22H26N4O3/c1-15(27)7-8-16-9-10-19(14-20(16)29-2)25-21(28)17-5-3-6-18(13-17)26-22-23-11-4-12-24-22/h3,5-6,9-10,13-14H,4,7-8,11-12H2,1-2H3,(H,25,28)(H2,23,24,26)