N-[(5-methylfuran-2-yl)methyl]-1-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(5-methylfuran-2-yl)methyl]-1-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: 1-(1-isopropylbenzotriazol-5-yl)sulfonyl-N-[(5-methyl-2-furyl)methyl]piperidine-3-carboxamide CAS Name: N-[(5-methyl-2-furanyl)methyl]-1-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[(5-methylfuran-2-yl)methyl]-1-(1-propan-2-ylbenzotriazol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: 1-(1-isopropylbenzotriazol-5-yl)sulfonyl-N-[(5-methyl-2-furyl)methyl]nipecotamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)N(N=N4)C(C)C

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)N(N=N4)C(C)C

InChI

InChI=1S/C21H27N5O4S/c1-14(2)26-20-9-8-18(11-19(20)23-24-26)31(28,29)25-10-4-5-16(13-25)21(27)22-12-17-7-6-15(3)30-17/h6-9,11,14,16H,4-5,10,12-13H2,1-3H3,(H,22,27)