methyl N-[3-(2-benzamidoethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate

Systemtic Name: methyl N-[3-(2-benzamidoethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate Openeye Name: methyl N-[3-(2-benzamidoethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate CAS Name: N-[3-(2-benzamidoethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamic acid methyl ester IUPAC Name: methyl N-[3-(2-benzamidoethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate Traditional Name: N-[3-(2-benzamidoethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamic acid methyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CN=C2C(=C1)C(=CN2)CCNC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)NC1=CN=C2C(=C1)C(=CN2)CCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O3/c1-25-18(24)22-14-9-15-13(10-20-16(15)21-11-14)7-8-19-17(23)12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3,(H,19,23)(H,20,21)(H,22,24)