N-[4-[4-[(4-fluorophenyl)carbamoylamino]piperidin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[4-[(4-fluorophenyl)carbamoylamino]piperidin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[4-[(4-fluorophenyl)carbamoylamino]-1-piperidyl]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[4-[[(4-fluoroanilino)-oxomethyl]amino]-1-piperidinyl]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[4-[(4-fluorophenyl)carbamoylamino]piperidin-1-yl]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[4-[(4-fluorophenyl)carbamoylamino]piperidino]-4-keto-butyl]thiophene-3-carboxamide Formula: C21H25FN4O3S MolecularWeight: 432.511603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC2=CC=C(C=C2)F)C(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)NC2=CC=C(C=C2)F)C(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C21H25FN4O3S/c22-16-3-5-17(6-4-16)24-21(29)25-18-7-11-26(12-8-18)19(27)2-1-10-23-20(28)15-9-13-30-14-15/h3-6,9,13-14,18H,1-2,7-8,10-12H2,(H,23,28)(H2,24,25,29)