4-azanyl-N,9-bis(prop-2-enyl)pyrimido[4,5-b]indole-2-carboxamide

Systemtic Name: 4-azanyl-N,9-bis(prop-2-enyl)pyrimido[4,5-b]indole-2-carboxamide Openeye Name: N,9-diallyl-4-amino-pyrimido[4,5-b]indole-2-carboxamide CAS Name: 4-amino-N,9-bis(prop-2-enyl)-2-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 4-amino-N,9-bis(prop-2-enyl)pyrimido[4,5-b]indole-2-carboxamide Traditional Name: N,9-diallyl-4-amino-pyrimid[4,5-b]indole-2-carboxamide Formula: C17H17N5O MolecularWeight: 307.34978

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=NC2=C(C3=CC=CC=C3N2CC=C)C(=N1)N

Isomeric SMILES

C=CCNC(=O)C1=NC2=C(C3=CC=CC=C3N2CC=C)C(=N1)N

InChI

InChI=1S/C17H17N5O/c1-3-9-19-17(23)15-20-14(18)13-11-7-5-6-8-12(11)22(10-4-2)16(13)21-15/h3-8H,1-2,9-10H2,(H,19,23)(H2,18,20,21)