4-(5-methylthiophen-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine

Systemtic Name: 4-(5-methylthiophen-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Openeye Name: 4-(5-methyl-2-thienyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine CAS Name: 4-(5-methyl-2-thiophenyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine IUPAC Name: 4-(5-methylthiophen-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepin-2-amine Traditional Name: [4-(5-methyl-2-thienyl)-6,7,8,9-tetrahydro-5H-pyrimid[4,5-b]azepin-2-yl]amine Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=C3CCCCNC3=NC(=N2)N

Isomeric SMILES

CC1=CC=C(S1)C2=C3CCCCNC3=NC(=N2)N

InChI

InChI=1S/C13H16N4S/c1-8-5-6-10(18-8)11-9-4-2-3-7-15-12(9)17-13(14)16-11/h5-6H,2-4,7H2,1H3,(H3,14,15,16,17)