N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-3-azanyl-pyrazine-2-carboxamide

Systemtic Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-3-azanyl-pyrazine-2-carboxamide Openeye Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-3-amino-pyrazine-2-carboxamide CAS Name: N-[4-[4-(2-acetamidoethyl)phenyl]-2-thiazolyl]-3-amino-2-pyrazinecarboxamide IUPAC Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-3-aminopyrazine-2-carboxamide Traditional Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-3-amino-pyrazinamide Formula: C18H18N6O2S MolecularWeight: 382.43952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NC=CN=C3N

Isomeric SMILES

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NC=CN=C3N

InChI

InChI=1S/C18H18N6O2S/c1-11(25)20-7-6-12-2-4-13(5-3-12)14-10-27-18(23-14)24-17(26)15-16(19)22-9-8-21-15/h2-5,8-10H,6-7H2,1H3,(H2,19,22)(H,20,25)(H,23,24,26)