N-[4-[2-oxidanylidene-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-oxidanylidene-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[2-oxo-3-(1-phenylethyl)hexahydropyrimidin-1-yl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[2-oxo-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[2-oxo-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[2-keto-3-(1-phenylethyl)hexahydropyrimidin-1-yl]phenyl]thiophene-2-carboxamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCCN(C2=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC(C1=CC=CC=C1)N2CCCN(C2=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H23N3O2S/c1-17(18-7-3-2-4-8-18)25-14-6-15-26(23(25)28)20-12-10-19(11-13-20)24-22(27)21-9-5-16-29-21/h2-5,7-13,16-17H,6,14-15H2,1H3,(H,24,27)