2-[(1R)-1-[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]ethyl]-1H-quinazolin-4-one Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(C)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)N[C@H](C)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H23N3OS/c1-3-16-10-12-17(13-11-16)21(20-9-6-14-28-20)24-15(2)22-25-19-8-5-4-7-18(19)23(27)26-22/h4-15,21,24H,3H2,1-2H3,(H,25,26,27)/t15-,21-/m1/s1