N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-1-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide

Systemtic Name: N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-1-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-1-[5-(1-piperidyl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide CAS Name: N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-1-[5-(1-piperidinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolecarboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-1-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-1-(5-piperidino-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Formula: C25H34N6OS MolecularWeight: 466.64206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCNC(=O)C1=CC=CN1C2=NN=C(S2)N3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)N(CCCNC(=O)C1=CC=CN1C2=NN=C(S2)N3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H34N6OS/c1-20(2)30(19-21-11-5-3-6-12-21)17-10-14-26-23(32)22-13-9-18-31(22)25-28-27-24(33-25)29-15-7-4-8-16-29/h3,5-6,9,11-13,18,20H,4,7-8,10,14-17,19H2,1-2H3,(H,26,32)