3-[[5-(aminomethyl)thiophen-2-yl]-cyclopropyl-methyl]-2-oxidanyl-6-(1-phenylbutan-2-yl)pyran-4-one

Systemtic Name: 3-[[5-(aminomethyl)thiophen-2-yl]-cyclopropyl-methyl]-2-oxidanyl-6-(1-phenylbutan-2-yl)pyran-4-one Openeye Name: 3-[[5-(aminomethyl)-2-thienyl]-cyclopropyl-methyl]-6-(1-benzylpropyl)-2-hydroxy-pyran-4-one CAS Name: 3-[[5-(aminomethyl)-2-thiophenyl]-cyclopropylmethyl]-2-hydroxy-6-(1-phenylbutan-2-yl)-4-pyranone IUPAC Name: 3-[[5-(aminomethyl)thiophen-2-yl]-cyclopropylmethyl]-2-hydroxy-6-(1-phenylbutan-2-yl)pyran-4-one Traditional Name: 3-[[5-(aminomethyl)-2-thienyl]-cyclopropyl-methyl]-6-(1-benzylpropyl)-2-hydroxy-pyran-4-one Formula: C24H27NO3S MolecularWeight: 409.54108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=C(S4)CN

Isomeric SMILES

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=C(S4)CN

InChI

InChI=1S/C24H27NO3S/c1-2-16(12-15-6-4-3-5-7-15)20-13-19(26)23(24(27)28-20)22(17-8-9-17)21-11-10-18(14-25)29-21/h3-7,10-11,13,16-17,22,27H,2,8-9,12,14,25H2,1H3